SCHEMBL29218809

SCHEMBL29218809

CCc1c(C)cc(C2(N)CCC(N)CC2)cc1C

nearest known ligand 0.35

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
OPRL1 P41146 1/20 0.33

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL29218609 0.82 OPRL1 (0.37) OPRL1
SCHEMBL29218567 0.80 OPRL1 (0.34) OPRL1
SCHEMBL29218544 0.77 OPRM1 (0.38) OPRL1
SCHEMBL29218643 0.76 OPRL1 (0.39) OPRL1
SCHEMBL31008897 0.76 OPRL1 (0.39) OPRL1
SCHEMBL29218804 0.72 OPRL1 (0.39) OPRL1
SCHEMBL25039647 0.70 SMYD3 (0.37)
SCHEMBL29218761 0.70 OPRL1 (0.34) OPRL1
SCHEMBL31008933 0.69 MAOB (0.47) OPRL1
SCHEMBL29218703 0.67 SPHK1 (0.42) OPRL1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118076581-A Iron death modulators, their preparation and use 维泰瑞隆有限公司 2024-05-24 CN disclosed